0 mol 7 unq 0 iso 0 dist 8.24774 5.30199 6.36911 11.4173 8.81608 6.88805 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.24774 12.8047 9.36807 11.4173 8.81608 13.156 numMergedOcc 0
2 mol 18 unq 0 iso 0 dist 9.23379 7.29389 8.52106 9.1579 9.35863 11.5747 numMergedOcc 0
3 mol 18 unq 1 iso 0 dist 9.23379 7.29389 8.52106 10.598 5.04478 6.11048 numMergedOcc 0
4 mol 18 unq 2 iso 0 dist 9.23379 8.02879 6.32451 9.1579 9.35863 6.96996 numMergedOcc 0
5 mol 18 unq 3 iso 0 dist 9.23379 8.02879 6.32451 10.598 5.04478 4.52259 numMergedOcc 0
6 mol 27 unq 0 iso 0 dist 6.32286 9.13877 9.77484 4.80888 6.78936 9.11842 numMergedOcc 0
7 mol 32 unq 0 iso 0 dist 9.87036 10.0829 8.68559 4.55585 7.11053 10.7345 numMergedOcc 0
8 mol 119 unq 0 iso 0 dist 5.94658 6.14531 7.39889 8.47329 6.55202 6.30721 numMergedOcc 0
9 mol 119 unq 1 iso 0 dist 5.94658 6.14531 7.39889 9.26434 9.08536 14.443 numMergedOcc 0
10 mol 119 unq 2 iso 0 dist 5.94658 10.2606 9.63176 8.47329 6.55202 6.9194 numMergedOcc 0
11 mol 119 unq 3 iso 0 dist 5.94658 10.2606 9.63176 9.26434 9.08536 9.68677 numMergedOcc 0
12 mol 119 unq 4 iso 0 dist 5.94658 5.56254 7.44174 8.47329 6.55202 12.4621 numMergedOcc 0
13 mol 119 unq 5 iso 0 dist 5.94658 5.56254 7.44174 9.26434 9.08536 6.20019 numMergedOcc 0
14 mol 134 unq 0 iso 0 dist 5.85438 9.22146 8.94837 4.71122 5.52149 11.5407 numMergedOcc 0
15 mol 134 unq 1 iso 0 dist 5.85438 6.20897 7.77454 4.71122 5.52149 5.91192 numMergedOcc 0
16 mol 224 unq 0 iso 0 dist 6.28968 13.4376 8.19953 10.1967 5.73591 5.13732 numMergedOcc 0
17 mol 225 unq 0 iso 0 dist 9.48966 10.3216 5.50387 13.9739 5.93063 4.7456 numMergedOcc 0
18 mol 235 unq 0 iso 0 dist 5.33951 9.50735 9.58736 8.35178 7.02029 13.7306 numMergedOcc 0
19 mol 235 unq 1 iso 0 dist 5.33951 7.96266 9.43058 8.35178 7.02029 7.31605 numMergedOcc 0
20 mol 235 unq 2 iso 0 dist 5.33951 7.31825 8.75735 8.35178 7.02029 4.12497 numMergedOcc 0
21 mol 235 unq 3 iso 0 dist 5.33951 10.75 6.98084 8.35178 7.02029 8.26028 numMergedOcc 0
22 mol 235 unq 4 iso 0 dist 5.33951 7.45266 7.32211 8.35178 7.02029 10.7187 numMergedOcc 0
23 mol 267 unq 0 iso 0 dist 8.21258 11.5235 8.76007 13.225 6.32877 11.5903 numMergedOcc 0
24 mol 267 unq 1 iso 0 dist 8.21258 11.5235 8.76007 14.8985 9.48115 9.15724 numMergedOcc 0
25 mol 267 unq 2 iso 0 dist 8.21258 11.5235 8.76007 12.5106 8.38545 5.65969 numMergedOcc 0
26 mol 267 unq 3 iso 0 dist 8.21258 11.5235 8.76007 5.54528 5.08174 9.22276 numMergedOcc 0
27 mol 267 unq 4 iso 0 dist 8.21258 11.5235 8.76007 6.62405 6.10838 6.06209 numMergedOcc 0
28 mol 267 unq 5 iso 0 dist 6.99549 7.48298 8.76007 10.0342 6.32877 11.5903 numMergedOcc 0
29 mol 267 unq 6 iso 0 dist 6.99549 7.48298 8.76007 9.59712 9.48115 9.15724 numMergedOcc 0
30 mol 267 unq 7 iso 0 dist 6.99549 7.48298 8.76007 10.8052 8.38545 5.65969 numMergedOcc 0
31 mol 267 unq 8 iso 0 dist 6.99549 7.48298 8.76007 7.45119 5.08174 9.22276 numMergedOcc 0
32 mol 267 unq 9 iso 0 dist 6.99549 7.48298 8.76007 6.1709 6.10838 6.06209 numMergedOcc 0
33 mol 272 unq 0 iso 0 dist 7.45793 6.54153 7.67853 3.87541 8.84523 5.12237 numMergedOcc 0
34 mol 272 unq 1 iso 0 dist 7.45793 6.54153 7.67853 8.80326 6.95241 5.41667 numMergedOcc 0
